ethyl 7-(trifluoromethyl)-4-[(2,4,6-trimethylphenyl)amino]quinoline-3-carboxylate

Systemtic Name: ethyl 7-(trifluoromethyl)-4-[(2,4,6-trimethylphenyl)amino]quinoline-3-carboxylate Openeye Name: ethyl 7-(trifluoromethyl)-4-(2,4,6-trimethylanilino)quinoline-3-carboxylate CAS Name: 7-(trifluoromethyl)-4-(2,4,6-trimethylanilino)-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 7-(trifluoromethyl)-4-(2,4,6-trimethylanilino)quinoline-3-carboxylate Traditional Name: 4-mesidino-7-(trifluoromethyl)quinoline-3-carboxylic acid ethyl ester Formula: C22H21F3N2O2 MolecularWeight: 402.40955

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C2C=C(C=CC2=C1NC3=C(C=C(C=C3C)C)C)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=CN=C2C=C(C=CC2=C1NC3=C(C=C(C=C3C)C)C)C(F)(F)F

InChI

InChI=1S/C22H21F3N2O2/c1-5-29-21(28)17-11-26-18-10-15(22(23,24)25)6-7-16(18)20(17)27-19-13(3)8-12(2)9-14(19)4/h6-11H,5H2,1-4H3,(H,26,27)